SCHEMBL7150712

SCHEMBL7150712

FC(F)(F)c1ccc(-c2nsc3cc(OCCCCC4CCN4)ccc23)cc1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LSS P48449 9/20 0.48
PPARD Q03181 2/20 0.36
PPARA Q07869 2/20 0.36
LTA4H P09960 1/20 0.35
TLR9 Q9NR96 1/20 0.35
KDM1A O60341 1/20 0.35
MAOB P27338 1/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7149946 0.89 LSS (0.46) LSSPPARDPPARAKDM1AMAOB
SCHEMBL7144752 0.87 LSS (0.63) LSS
SCHEMBL7148486 0.82 LSS (0.49) LSSPPARDPPARA
SCHEMBL5035448 0.82 LSS (0.54) LSSPPARDPPARAMAOB
SCHEMBL5045466 0.81 LSS (0.64) LSSLTA4HTLR9MAOBSLC6A2
SCHEMBL7149907 0.81 LTA4H (0.48) PPARDPPARALTA4H
SCHEMBL7146656 0.81 LSS (0.60) LSS
SCHEMBL5035262 0.80 LSS (0.63) LSSLTA4HTLR9MAOBSLC6A2
SCHEMBL5039022 0.80 LSS (0.58) LSS
SCHEMBL5035491 0.78 LSS (0.68) LSS

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1334094-A1 CHOLESTEROL LOWERING BENZO[B]THIOPHENES AND BENZO[D]ISOTHIAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2003-08-13 EP disclosed
WO-2002036584-A1 CHOLESTEROL LOWERING BENZO`B! THIOPHENES AND BENZO`D! ISOTHIAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2002-05-10 WO disclosed